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SCHEMBL14441992

SCHEMBL14441992

C=C1C(=O)OC2(CCC3(CC2)OC(=O)C(/C=C/C=C/C=C2C(=O)OC4(CCC5(CC4)OC(=O)C(/C=C/C=C/C=C4C(=O)OC6(CCCCC6)OC4=O)=C(O)O5)OC2=O)=C(O)O3)OC1=O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ APP P05067 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ RECQL P46063 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12715212 0.94 ALDH1A1 (0.35) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12715127 0.94 ALDH1A1 (0.35) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12545104 0.92 ALDH1A1 (0.36) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL13397808 0.92 ALDH1A1 (0.36) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12544909 0.92 ALDH1A1 (0.36) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL14441991 0.90 ALDH1A1 (0.32) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12715157 0.88 ALDH1A1 (0.34) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12715152 0.88 ALDH1A1 (0.34) ALDH1A1KDM4EAPPMEN1KMT2A
SCHEMBL12216526 0.87 ALDH1A1 (0.37) ALDH1A1KDM4EMEN1KMT2ACYP1A2
SCHEMBL12216525 0.86 ALDH1A1 (0.35) ALDH1A1KDM4EMEN1KMT2ACYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238461-B2 Optical information-recording medium, novel oxonol compound and method of recording information FUJIFILM CORPORATION (JP) 2007-07-03 — — US disclosed
US-7238461-B2 Optical information-recording medium, novel oxonol compound and method of recording information FUJIFILM CORPORATION (JP) 2007-07-03 — — US disclosed
US-20070020562-A1 Optical information-recording medium, novel oxonol compound and method of recording information FUJI PHOTO FILM CO., LTD. 2007-01-25 — — US disclosed
US-20070020562-A1 Optical information-recording medium, novel oxonol compound and method of recording information FUJI PHOTO FILM CO., LTD. 2007-01-25 — — US disclosed
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